Basic information
- Standard SMILES
CS(=O)(=O)O.c1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1- InChIKey
MMIAUUPWJOPREH-NBLXOJGSSA-N- Molecular formula
- C20H25NO6S
- Average molar mass
- 407.5 g/mol
- Monoisotopic mass
- 407.14025869
Names & identifiers
- Preferred name
- Paroxetine Impurity 10
- IUPAC
- (3S,4R)-3-(1,3-benzodioxol-5-yloxymethyl)-4-phenylpiperidine;methanesulfonic acid
Names & synonyms
Paroxetine Impurity 10MMIAUUPWJOPREH-NBLXOJGSSA-NAKOS025402009AC-28140NS00126144
Database identifiers
- PubChem CID
- 206527
Properties
Computed structural properties
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 464
Related reactions
3 records
Compound notes
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